SCHEMBL19984625

SCHEMBL19984625

CC(C)(C)OC(=O)NC1CCC(C(O)c2ncc(CO[Si](C)(C)C(C)(C)C)s2)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ JAK1 P23458 6/20 0.36
▸ JAK2 O60674 3/20 0.36
▸ DRD2 P14416 4/20 0.36
▸ KDM4D Q6B0I6 1/20 0.35
▸ CKS1B P61024 1/20 0.35
▸ SKP1 P63208 1/20 0.35
▸ SKP2 Q13309 1/20 0.35
▸ KCNA3 P22001 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ GAA P10253 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ LIPG Q9Y5X9 1/20 0.33
▸ MERTK Q12866 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19984629 0.83 JAK1 (0.33) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL19984631 0.82 DRD2 (0.40) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL21250402 0.80 KCNA3 (0.43) DRD2KDM4DCKS1BSKP1SKP2
SCHEMBL22961620 0.74 KDM1A (0.40) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL22961612 0.71 BTK (0.38) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL19984626 0.69 DRD2 (0.43) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL21229097 0.69 L3MBTL1 (0.39) GAA
SCHEMBL22859881 0.68 BTK (0.42) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL19984621 0.68 DRD2 (0.42) KDM1AMAOBJAK1JAK2DRD2
SCHEMBL19984632 0.68 DRD2 (0.42) KDM1AMAOBJAK1JAK2DRD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2022-01-27 — — US disclosed
US-10987360-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2021-04-27 — — US disclosed
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 — — US disclosed
WO-2018053157-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2018-03-22 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10987360-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS KDM1A 3124/4885MAOB 3310/4885JAK1 2998/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS KDM1A 3124/4885MAOB 3310/4885JAK1 2998/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS KDM1A 3124/4885MAOB 3310/4885JAK1 2998/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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